SCHEMBL28656162

SCHEMBL28656162

CC(=O)CC(=O)NS(=O)(=O)c1ccc(N)cc1.CCN(CC)CC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.59
TSHR P16473 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
ALDH1A1 P00352 3/20 0.58
FBP1 P09467 1/20 0.47
CA1 P00915 6/20 0.47
CA2 P00918 6/20 0.47
CA12 O43570 2/20 0.47
CA9 Q16790 2/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
KMT2A Q03164 1/20 0.47
MMP1 P03956 1/20 0.45
MMP2 P08253 1/20 0.45
MMP9 P14780 1/20 0.45
MMP8 P22894 1/20 0.45
MMP13 P45452 1/20 0.45
HTR6 P50406 2/20 0.44
CA4 P22748 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Sulfacetamide SCHEMBL28653550 0.88 SMN1; SMN2 (0.78) DHFRTSHRSMN1; SMN2TDP1ALDH1A1
SCHEMBL15650208 0.81 ALDH1A1 (0.69) DHFRTSHRSMN1; SMN2TDP1ALDH1A1
SCHEMBL4464537 0.79 CA1 (0.70) DHFRTSHRSMN1; SMN2TDP1ALDH1A1
SCHEMBL5458800 0.78 ALDH1A1 (0.65) DHFRTSHRSMN1; SMN2TDP1ALDH1A1
SCHEMBL29289293 0.77 TSHR (0.42) DHFRTSHRSMN1; SMN2TDP1ALDH1A1
SCHEMBL28405273 0.76 EGFR (0.60) TSHRSMN1; SMN2TDP1ALDH1A1CA1
SCHEMBL21082820 0.76 ALDH1A1 (0.61) DHFRTSHRSMN1; SMN2TDP1ALDH1A1
Sulfacetamide SCHEMBL28122264 0.76 SMN1; SMN2 (1.00) DHFRTSHRSMN1; SMN2TDP1ALDH1A1
Sulfacetamide SCHEMBL40863 0.76 SMN1; SMN2 (1.00) DHFRTSHRSMN1; SMN2TDP1ALDH1A1
SCHEMBL3146545 0.75 ALDH1A1 (0.60) DHFRTSHRSMN1; SMN2TDP1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113861083-A Preparation method of acetoacetyl sulfanilamide triethylamine salt 南通醋酸化工股份有限公司 2021-12-31 CN claimed
CN-113861083-A Preparation method of acetoacetyl sulfanilamide triethylamine salt 南通醋酸化工股份有限公司 2021-12-31 CN disclosed
CN-113861083-A Preparation method of acetoacetyl sulfanilamide triethylamine salt 南通醋酸化工股份有限公司 2021-12-31 CN disclosed
CN-113861083-A Preparation method of acetoacetyl sulfanilamide triethylamine salt 南通醋酸化工股份有限公司 2021-12-31 CN disclosed
CN-113788802-A Method for preparing acesulfame potassium 南通醋酸化工股份有限公司 2021-12-14 CN disclosed
CN-113563284-A Preparation method of acesulfame potassium composition 南通醋酸化工股份有限公司 2021-10-29 CN disclosed
CN-113563283-A Preparation method of acesulfame potassium composition 南通醋酸化工股份有限公司 2021-10-29 CN disclosed